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Substance Name: Digitoxose
RN: 527-52-6
UNII: A4R5906C56
InChIKey: JWFRNGYBHLBCMB-NGJCXOISSA-N

Molecular Formula

  • C6-H12-O4

Molecular Weight

  • 148.157
 
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Names and Synonyms

Name of Substance

  • Digitoxose

Synonyms

  • 2,6-Dideoxy-D-altrose
  • 2,6-Dideoxy-D-ribohexose
  • 2,6-Dideoxy-D-ribohexose [IUPAC]
  • Altrose, 2,6-dideoxy-, D-
  • D-Digitoxose
  • EINECS 208-416-6
  • NSC 87513
  • UNII-A4R5906C56

Systematic Names

  • 2,6-Dideoxy-D-altrose
  • 2,6-Dideoxy-D-ribo-hexose
  • D-ribo-Hexose, 2,6-dideoxy- (9CI)
  • Digitoxose (VAN) (8CI)

Registry Numbers

CAS Registry Number

  • 527-52-6

FDA UNII

  • A4R5906C56

System Generated Number

  • 0000527526

Structure Descriptors

InChI

1S/C6H12O4/c1-4(8)6(10)5(9)2-3-7/h3-6,8-10H,2H2,1H3/t4-,5+,6-/m1/s1

InChIKey

JWFRNGYBHLBCMB-NGJCXOISSA-N

Smiles

[CH][C@H]([C@H]([C@H]([CH]C=O)O)O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 112 deg C   EXP
log P (octanol-water) -1.770 (none)   EST
Atmospheric OH Rate Constant 5.30E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.